Physical property and gas transport studies of ultrathin polysulfone membrane from 298.15 to 328.15 K and 2 to 50 bar: atomistic molecular simulation and empirical modelling.

Elucidation of ultrathin polymeric membrane at the laboratory scale is complicated at different operating conditions due to limitation of instruments to obtain in situ measurement data of membrane physical properties. This is essential since their effects are reversible. In addition, tedious experimental work is required to collect gas transport data at varying operating conditions. Recently, we have proposed a validated Soft Confining Methodology for Ultrathin Films that can be used to simulate ultrathin polysulfone (PSF) membranes upon confinement limited to 308.15 K and 2 bars. In industry application, these ultrathin membranes are operated within 298.15-328.15 K and up to 50 bars. Therefore, our proposed methodology using computational chemistry has been adapted to circumvent limitation in experimental study by simulating ultrathin PSF membranes upon confinement at different operating temperatures (298.15 to 328.15 K) and pressures (2 to 50 bar). The effect of operating parameters towards non-bonded and potential energy, free volume, specific volume and gas transport data (e.g. solubility and diffusivity) for oxygen and nitrogen of the ultrathin films has been simulated and collected using molecular simulation. Our previous empirical equations that have been confined to thickness dependent gas transport properties have been modified to accommodate the effect of operating parameters. The empirical equations are able to provide a good quantitative characterization with R 2 ≥ 0.99 consistently, and are able to be interpolated to predict gas transport properties within the range of operating conditions. The modified empirical model can be utilized in process optimization studies to determine optimal membrane design for typical membrane specifications and operating parameters used in industrial applications.

Mathematical modelling of thickness and temperature dependent physical aging to O2/N2 gas separation in polymeric membranes.

Polymeric membranes are glassy materials at non-equilibrium state and inherently undergo a spontaneous evolution towards equilibrium known as physical aging. Volume relaxation characteristic during the course of aging is governed by the surrounding temperature in which the polymeric material is aged. Although there are studies to understand how polymeric materials evolve over time towards equilibrium at different operating temperatures, the theories have been developed merely in response to experimental observations and phenomenological theory at bulk glassy state without the implementation of sample size effects. Limited work has been done to characterize the physical aging process to thin polymeric films using reasonable physical parameters and mathematical models with incorporation of thermodynamics and film thickness consideration. The current work applies the Tait equation of states and thickness dependent glass transition temperature, integrated within a simple linear correlation, to model the temperature and thickness dependent physical aging. The mathematical model has been validated with experimental aging data, whereby a small deviation is observed that has been explained by intuitive reasoning pertaining to the thermodynamic parameters. The mathematical model has been further employed to study the gas transport properties of O2 and N2, which is anticipated to be applied in oxygen enriched combustion for generation of cleaner and higher efficiency fuel in future work.

High frequency ultrasonic-assisted CO2 absorption in a high pressure water batch system.

Physical absorption process is always nullified by the presence of cavitation under low frequency ultrasonic irradiation. In the present study, high frequency ultrasonic of 1.7MHz was used for the physical absorption of CO2 in a water batch system under elevated pressure. The parameters including ultrasonic power and initial feed pressure for the system have been varied from 0 to 18W and 6 to 41bar, respectively. The mass transfer coefficient has been determined via the dynamic pressure-step method. Besides, the actual ultrasonic power that transmitted to the liquid was measured based on calorimetric method prior to the absorption study. Subsequently, desorption study was conducted as a comparison with the absorption process. The mechanism for the ultrasonic assisted absorption has also been discussed. Based on the results, the mass transfer coefficient has increased with the increasing of ultrasonic power. It means that, the presence of streaming effect and the formation of liquid fountain is more favorable under high frequency ultrasonic irradiation for the absorption process. Therefore, high frequency ultrasonic irradiation is suggested to be one of the potential alternatives for the gas separation process with its promising absorption enhancement and compact design.

Synthesis and thermal degradation studies of melamine formaldehyde resins.

Melamine formaldehyde (MF) resins have been synthesized at different reaction temperature and pH values. Different molar ratios of melamine and formaldehyde were used to synthesize the corresponding resins. The prepared resin samples were characterized by using molecular weight determination viscometry and thermogravimetric analysis (TGA). The maximum percentage of solid content (69.7%) was obtained at pH 8.5 and 75°C temperature. The molecular weight of MF resin was increased with an increase of melamine monomer concentration. The highest residual weight 14.125 wt.% was obtained with sample 10.